Geometry & MOs

Info

ID:	244353
PubChem CID:	99344231
Reduced:	N2O5C19H20 (1)
Stoich.:	A2B5C19D20 (1)
Weight, g/mol:	387.088892
ΔH_f, kcal/mol:	-172.45
Dipole, Da:	3.81
IP(EA), eV:	-8.96(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,3-dimethyl-5-[[2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)C(=O)OC)NC(=O)C2=CC(=CC=C2)OCC(=O)N

DOS

IR

Vibrations